Geometry & MOs

Info

ID:	407035
PubChem CID:	135079183
Reduced:	OC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-93.92
Dipole, Da:	3.57
IP(EA), eV:	-8.98(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S,2S)-1-hydroxy-1-phenylpropan-2-yl]-N,3,3-trimethylbutanamide

Drug info:

PubChemData

Smile

CC(=C(C)COC(C)(C)C=O)C

DOS

IR

Vibrations